SCHEMBL6313012

SCHEMBL6313012

C[C@H](c1ccc2ccccc2c1)N1CCC(N)CC1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 2/20 0.53
DRD4 P21917 1/20 0.49
UGT2B7 P16662 1/20 0.45
HSD11B1 P28845 2/20 0.44
CYP2D6 P10635 1/20 0.43
MAPT P10636 1/20 0.43
OGA O60502 2/20 0.42
SLC6A2 P23975 1/20 0.41
SLC6A4 P31645 1/20 0.41
SLC6A3 Q01959 1/20 0.41
DKK1 O94907 1/20 0.41
MBTD1 Q05BQ5 1/20 0.41
L3MBTL3 Q96JM7 1/20 0.41
MC4R P32245 1/20 0.39
AOC3 Q16853 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6208247 1.00 MCHR1 (0.53) MCHR1DRD4UGT2B7HSD11B1CYP2D6
SCHEMBL6187443 1.00 MCHR1 (0.53) MCHR1DRD4UGT2B7HSD11B1CYP2D6
SCHEMBL8983490 0.82 UGT2B7 (0.52) MCHR1DRD4UGT2B7HSD11B1CYP2D6
SCHEMBL31046817 0.82 UGT2B7 (0.52) MCHR1DRD4UGT2B7HSD11B1CYP2D6
SCHEMBL6331798 0.81 OGA (0.54) MAPTOGA
SCHEMBL6946061 0.80 CYP2D6 (0.68) DRD4CYP2D6MBTD1L3MBTL3MC4R
SCHEMBL1803482 0.80 CYP2D6 (0.68) DRD4CYP2D6MBTD1L3MBTL3MC4R
Hydrochloric Acid SCHEMBL8786946 0.79 CYP2D6 (0.66) DRD4CYP2D6MBTD1L3MBTL3MC4R
Hydrochloric Acid SCHEMBL11532334 0.79 CYP2D6 (0.66) DRD4CYP2D6MBTD1L3MBTL3MC4R
SCHEMBL6206243 0.78 HSD11B1 (0.57) MCHR1DRD4UGT2B7HSD11B1CYP2D6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6921821-B2 Antagonists of melanin concentrating hormone receptor ABBOTT LABORATORIES (US) 2005-07-26 US disclosed
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MILLENNIUM PHARMACEUTICALS, INC. 2004-06-03 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040106645-A1 Antagonists of melanin concentrating hormone receptor MCHR1, MCHR2, MC1R MCHR1 1/4885DRD4 828/4885UGT2B7 425/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.